[1-(azetidin-3-yl)-4-ethylpiperidin-4-yl]methanol

C11H22N2O — CID 131208924

IUPAC[1-(azetidin-3-yl)-4-ethylpiperidin-4-yl]methanol
SMILESCCC1(CO)CCN(C2CNC2)CC1
InChIInChI=1S/C11H22N2O/c1-2-11(9-14)3-5-13(6-4-11)10-7-12-8-10/h10,12,14H,2-9H2,1H3
InChIKeySTIUYJCOFPGTGL-UHFFFAOYSA-N
MW198.31 g/mol
LogP0.44
Rot. Bonds3

About [1-(azetidin-3-yl)-4-ethylpiperidin-4-yl]methanol

[1-(azetidin-3-yl)-4-ethylpiperidin-4-yl]methanol (PubChem CID 131208924) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is [1-(azetidin-3-yl)-4-ethylpiperidin-4-yl]methanol.

Molecular Properties

Compound Name[1-(azetidin-3-yl)-4-ethylpiperidin-4-yl]methanol
PubChem CID131208924
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name[1-(azetidin-3-yl)-4-ethylpiperidin-4-yl]methanol
SMILESCCC1(CO)CCN(C2CNC2)CC1
InChIInChI=1S/C11H22N2O/c1-2-11(9-14)3-5-13(6-4-11)10-7-12-8-10/h10,12,14H,2-9H2,1H3
InChIKeySTIUYJCOFPGTGL-UHFFFAOYSA-N
XLogP0.44
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4,4-diethyl-1-(4-methylsulfanylpyrrolidin-3-yl)piperidine
CID 82760659
3-(azetidin-3-yl)-3,9-diazaspiro[5.5]undecane
CID 169257836
(1-ethylcycloheptyl)methanol
CID 56982411
4-(3,3-diethylpyrrolidin-1-yl)cyclohexan-1-ol
CID 114762652
1-(azetidin-3-yl)-4-methylpiperazine
CID 20659800
2-[1-(azetidin-3-yl)piperidin-4-yl]ethanol
CID 131171989
(1-cyclopentyl-4-methylpiperidin-4-yl)methanol
CID 83915889
ethane;(4-ethyloxan-4-yl)methanol
CID 143573647
4-(4-ethyl-4-methylpiperidin-1-yl)pyrrolidin-3-ol
CID 63702374
1-amino-3-(4,4-diethylpiperidin-1-yl)cyclopentane-1-carboxamide
CID 79651839
1-(azetidin-3-yl)-4-(3-ethylcyclopentyl)piperazine
CID 66202501
3-(3,3-diethylpyrrolidin-1-yl)cyclobutan-1-amine
CID 80561870

Frequently Asked Questions

What is the IUPAC name of [1-(azetidin-3-yl)-4-ethylpiperidin-4-yl]methanol?
The IUPAC name of [1-(azetidin-3-yl)-4-ethylpiperidin-4-yl]methanol (CID 131208924) is [1-(azetidin-3-yl)-4-ethylpiperidin-4-yl]methanol.
What is the SMILES notation for [1-(azetidin-3-yl)-4-ethylpiperidin-4-yl]methanol?
The canonical SMILES for [1-(azetidin-3-yl)-4-ethylpiperidin-4-yl]methanol is CCC1(CO)CCN(C2CNC2)CC1.
What is the InChIKey of [1-(azetidin-3-yl)-4-ethylpiperidin-4-yl]methanol?
The InChIKey is STIUYJCOFPGTGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-2-11(9-14)3-5-13(6-4-11)10-7-12-8-10/h10,12,14H,2-9H2,1H3.
What are the key properties of [1-(azetidin-3-yl)-4-ethylpiperidin-4-yl]methanol?
[1-(azetidin-3-yl)-4-ethylpiperidin-4-yl]methanol has a molecular weight of 198.31 g/mol, XLogP of 0.44, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(azetidin-3-yl)-4-ethylpiperidin-4-yl]methanol is sourced from PubChem (CID 131208924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).